* LIGAND DATABASE FILE (OPLS2005)
*
001      52    52     90    140     268
    1     0 S   NP   _N1_     1    28.80363    95.47718   -23.44270
    2     1 S   H    _HN1     2     1.02828    32.22548   170.16899
    3     1 S   H    _H1_     3     1.02787   106.62562   -92.50645
    4     1 S   H    _H2_     4     1.02950    77.34862    13.15615
    5     1 S   CT   _CA1     5     1.50114   134.63008   119.44396
    6     5 S   HC   _HA1     6     1.09573   105.18979    85.43327
    7     5 S   CO3  _C1_     7     1.53782   112.46613   -34.79664
    8     7 S   O2Z  _O11     8     1.26372   115.00461   -42.52637
    9     7 S   O2Z  _O12     9     1.26240   114.94462   136.58985
   10     5 S   CT   _CB1    10     1.53077   107.41890  -156.58825
   11    10 S   HC   HB11    11     1.09834   109.35646   -49.71573
   12    10 S   HC   HB12    12     1.09813   110.45525    66.88780
   13    10 S   CT   _CG1    13     1.52997   112.61523  -170.68928
   14    13 S   HC   HG11    14     1.09580   110.64773   -66.03741
   15    13 S   HC   HG12    15     1.09671   109.76960    53.19804
   16    13 S   C    _CD1    16     1.51803   112.19040   173.65016
   17    16 S   O    _OE1    17     1.22735   123.27105     7.85823
   18    16 S   N    _N2_    18     1.38660   111.70395  -172.21495
   19    18 S   H    _HN2    19     1.01579   118.92019     1.65138
   20    18 S   CT1  _CA2    20     1.46197   123.37447   177.20467
   21    20 S   HC   _HA2    21     1.09738   109.37766     3.72215
   22    20 S   C    _C2_    22     1.53578   108.52621  -111.76019
   23    22 S   O    _O2_    23     1.23060   122.28527  -147.02452
   24    20 S   CT   _CB2    32     1.53424   111.69652   125.76766
   25    24 S   HC   HB21    33     1.09525   109.79016    56.44615
   26    24 S   HC   HB22    34     1.09377   109.72377   175.31901
   27    22 S   N    _N3_    24     1.38326   113.71097    40.33354
   28    27 S   H    _HN3    25     1.01578   119.60421    -3.17077
   29    24 S   S    _SG2    35     1.82809   111.33680   -64.18037
   30    27 S   CT   _CA3    26     1.45288   123.22922   177.21273
   31    30 S   HC   HA31    27     1.09548   107.49263   -65.06140
   32    30 S   HC   HA32    28     1.09556   108.00949    51.38608
   33    29 S   CT   _C8_    36     1.86080   101.14116  -174.05759
   34    30 S   CO3  _C3_    29     1.52966   114.06646   173.39176
   35    34 S   O2Z  _O31    30     1.26378   116.06555    -0.84023
   36    34 S   O2Z  _O32    31     1.26427   114.41314   179.22798
   37    33 S   CM   _C7_    37     1.52384   110.48549  -170.44422
   38    37 S   Cl   Cl1_    38     1.73895   118.98991    43.77122
   39    33 S   OH   _O34    51     1.43662   110.06227   -54.91268
   40    39 S   HO   _H7_    52     0.97050   108.06921    68.71721
   41    37 S   CM   _C6_    39     1.34389   122.66634  -142.24316
   42    41 S   HC   _H5_    40     1.08655   120.33362  -178.02553
   43    41 S   CM   _C5_    41     1.44435   121.71489    -1.20950
   44    43 S   CM   _C4_    42     1.34112   120.66040    11.56558
   45    44 S   HC   _H4_    43     1.08678   120.84730   178.81700
   46    43 S   CO3  _C10    48     1.54325   118.24164  -169.09449
   47    46 S   O2Z  _O36    49     1.26552   115.86107    21.83974
   48    46 S   O2Z  _O35    50     1.26584   115.78807  -158.27742
   49    33 S   CT   _C9_    44     1.57290   110.66251    65.11066
   50    49 S   HC   _H3_    45     1.09671   109.29223   -88.15028
   51    49 S   OH   _O33    46     1.43044   112.95446    30.83137
   52    51 S   HO   _H6_    47     0.97298   107.56848    51.69079
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  13   2   1   1  11   5   6   1   8   3   8   8   4   3   1   1
   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    49    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    44    49    50    51    39    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    43    44    45    49    50    51    52    39    40  
   35    36  
   36  
    0  
   38    41    42    43    44    49    50    51    46    39    40  
   41    42    43    49    39  
   40    41    44    49    50    51  
   49  
   42    43    44    45    49    46    47    48  
   43    44    46  
   44    45    49    50    51    46    47    48  
   45    49    50    51    52    46    47    48  
   49    50    51    46  
   47    48    49  
   48  
    0  
   50    51    52  
   51    52  
   52  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.432500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   39   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   40   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   41   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0760  -0.310300   2.0020   1.7750   0.023028004  -0.852763146
   44   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   49   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    49   268.000  1.529
   33    39   320.000  1.410
   37    38   300.000  1.725
   37    41   549.000  1.340
   41    42   340.000  1.080
   41    43   380.000  1.444
   43    44   549.000  1.340
   43    46   230.000  1.545
   44    45   340.000  1.080
   44    49   317.000  1.510
   49    50   340.000  1.090
   49    51   320.000  1.410
   51    52   553.000  0.945
   46    47   656.000  1.250
   46    48   656.000  1.250
   39    40   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    49    75.00000  111.63000
   29    33    39    85.00000  114.68000
   33    37    38    75.00000  111.02000
   33    37    41    70.00000  124.00000
   33    49    44    70.00000  112.02700
   33    49    50    37.50000  110.70000
   33    49    51    50.00000  109.50000
   33    39    40    55.00000  108.50000
   37    41    42    35.00000  120.00000
   37    41    43    70.00000  123.01800
   41    37    38    75.00000  121.50000
   41    43    44    70.00000  123.01800
   41    43    46    55.00000  124.75400
   43    41    42    35.00000  120.00000
   43    44    45    35.00000  120.00000
   43    44    49    70.00000  124.00000
   43    46    47    85.00000  113.83300
   43    46    48    85.00000  113.83300
   44    49    50    35.00000  109.50000
   44    49    51    90.00000  110.39200
   49    33    37    70.00000  112.02700
   49    44    45    35.00000  117.00000
   49    51    52    55.00000  108.50000
   51    49    50    35.00000  109.50000
   46    43    44    55.00000  124.75400
   48    46    47    80.00000  126.00000
   39    33    37    90.00000  110.39200
   39    33    49    50.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   0.21350  1.0 3.0
   24    29    33    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.09700  1.0 1.0
   29    33    37    38   0.15600 -1.0 2.0
   29    33    37    38  -0.50800  1.0 3.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    49    44   0.56750  1.0 1.0
   29    33    49    44  -0.07550 -1.0 2.0
   29    33    49    44   0.20000  1.0 3.0
   29    33    49    50   0.15000  1.0 3.0
   29    33    49    51   0.56750  1.0 1.0
   29    33    49    51  -0.07550 -1.0 2.0
   29    33    49    51   0.20000  1.0 3.0
   29    33    39    40   0.35600  1.0 1.0
   29    33    39    40  -0.10750 -1.0 2.0
   29    33    39    40  -0.54400  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    43   7.00000 -1.0 2.0
   33    49    51    52  -0.11600  1.0 1.0
   33    49    51    52  -0.09450 -1.0 2.0
   33    49    51    52   0.21250  1.0 3.0
   37    33    49    44   0.31000  1.0 1.0
   37    33    49    44   0.14700 -1.0 2.0
   37    33    49    44   0.07550  1.0 3.0
   37    33    49    50   0.15000  1.0 3.0
   37    33    49    51   1.05650  1.0 1.0
   37    33    49    51   0.15600 -1.0 2.0
   37    33    49    51   0.53150  1.0 3.0
   37    33    39    40  -0.07800  1.0 1.0
   37    33    39    40  -0.21500 -1.0 2.0
   37    33    39    40  -0.03150  1.0 3.0
   37    41   -43    44   0.28850  1.0 1.0
   37    41   -43    44   2.61350 -1.0 2.0
   37    41   -43    44   0.78400  1.0 3.0
   37    41    43    46  -0.18600  1.0 3.0
   38    37    41    42   7.00000 -1.0 2.0
   38    37    41    43   7.00000 -1.0 2.0
   41    43    44    45   7.00000 -1.0 2.0
   41    43    44    49   7.00000 -1.0 2.0
   41    43    46    47  -0.04000 -1.0 2.0
   41    43    46    47  -0.29050  1.0 3.0
   41    43    46    48  -0.04000 -1.0 2.0
   41    43    46    48  -0.29050  1.0 3.0
   42    41    43    44  -0.18600  1.0 3.0
   42    41    43    46   0.00000  1.0 1.0
   43    44   -49    33   0.09850  1.0 1.0
   43    44   -49    33   0.15250 -1.0 2.0
   43    44   -49    33  -0.50650  1.0 3.0
   43    44    49    50   0.00000  1.0 1.0
   43    44    49    51   0.67800  1.0 1.0
   43    44    49    51   0.47050 -1.0 2.0
   43    44    49    51  -0.62500  1.0 3.0
   44    43    46    47  -0.04000 -1.0 2.0
   44    43    46    47  -0.29050  1.0 3.0
   44    43    46    48  -0.04000 -1.0 2.0
   44    43    46    48  -0.29050  1.0 3.0
   44    49    51    52  -0.07800  1.0 1.0
   44    49    51    52  -0.21500 -1.0 2.0
   44    49    51    52  -0.03150  1.0 3.0
   45    44    49    33   0.00000  1.0 1.0
   45    44    49    50   0.33100  1.0 3.0
   45    44    49    51   0.00000  1.0 1.0
   49    33    37    38   0.09700  1.0 1.0
   49    33    37    38   0.15600 -1.0 2.0
   49    33    37    38  -0.50800  1.0 3.0
   49    33   -37    41   0.09850  1.0 1.0
   49    33   -37    41   0.15250 -1.0 2.0
   49    33   -37    41  -0.50650  1.0 3.0
   49    33    39    40  -0.11600  1.0 1.0
   49    33    39    40  -0.09450 -1.0 2.0
   49    33    39    40   0.21250  1.0 3.0
   50    49    51    52   0.19450  1.0 3.0
   46    43    44    45   7.00000 -1.0 2.0
   46    43    44    49   7.00000 -1.0 2.0
   39    33    37    38   0.09700  1.0 1.0
   39    33    37    38   0.15600 -1.0 2.0
   39    33    37    38  -0.50800  1.0 3.0
   39    33    37    41   0.67800  1.0 1.0
   39    33    37    41   0.47050 -1.0 2.0
   39    33    37    41  -0.62500  1.0 3.0
   39    33    49    44   1.05650  1.0 1.0
   39    33    49    44   0.15600 -1.0 2.0
   39    33    49    44   0.53150  1.0 3.0
   39    33    49    50   0.23400  1.0 3.0
   39    33    49    51   3.75450  1.0 1.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    41   1.10000 -1.0 2.0
   43    42    41    37   1.10000 -1.0 2.0
   41    46    43    44   1.10000 -1.0 2.0
   49    45    44    43   1.10000 -1.0 2.0
   47    43    46    48  10.50000 -1.0 2.0
END
